Geometry & MOs

Info

ID:	340839
PubChem CID:	127263274
Reduced:	ClNO2C12H16 (1)
Stoich.:	ABC2D12E16 (1)
Weight, g/mol:	277.148538
ΔH_f, kcal/mol:	-109.18
Dipole, Da:	3.62
IP(EA), eV:	-10.26(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxylate

Drug info:

PubChemData

Smile

C1CC(CNC1)C2=CC(=CC=C2)C(=O)O.Cl

DOS

IR

Vibrations